2-[3-[5-(4-carbamimidoylphenoxy)pentoxy]phenyl]-1-benzofuran-6-carboximidamide dihydrochloride

Systemtic Name: 2-[3-[5-(4-carbamimidoylphenoxy)pentoxy]phenyl]-1-benzofuran-6-carboximidamide dihydrochloride Openeye Name: 2-[3-[5-(4-carbamimidoylphenoxy)pentoxy]phenyl]benzofuran-6-carboxamidine dihydrochloride CAS Name: 2-[3-[5-(4-carbamimidoylphenoxy)pentoxy]phenyl]-6-benzofurancarboximidamide dihydrochloride IUPAC Name: 2-[3-[5-(4-carbamimidoylphenoxy)pentoxy]phenyl]-1-benzofuran-6-carboximidamide dihydrochloride Traditional Name: 2-[3-[5-(4-amidinophenoxy)pentoxy]phenyl]benzofuran-6-carboxamidine dihydrochloride Formula: C27H30Cl2N4O3 MolecularWeight: 529.4581

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCCCOC2=CC=C(C=C2)C(=N)N)C3=CC4=C(O3)C=C(C=C4)C(=N)N.Cl.Cl

Isomeric SMILES

C1=CC(=CC(=C1)OCCCCCOC2=CC=C(C=C2)C(=N)N)C3=CC4=C(O3)C=C(C=C4)C(=N)N.Cl.Cl

InChI

InChI=1S/C27H28N4O3.2ClH/c28-26(29)18-9-11-22(12-10-18)32-13-2-1-3-14-33-23-6-4-5-19(15-23)24-16-20-7-8-21(27(30)31)17-25(20)34-24;;/h4-12,15-17H,1-3,13-14H2,(H3,28,29)(H3,30,31);2*1H